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Home > Bromides > 1261878-59-4
1261878-59-4 | (4-Bromo-2-methoxy-phenyl)-acetic acid methyl ester
CAS No: 1261878-59-4 Catalog No: AG01ERH2 MDL No:
Product Description
Catalog Number:
AG01ERH2
Chemical Name:
(4-Bromo-2-methoxy-phenyl)-acetic acid methyl ester
CAS Number:
1261878-59-4
Molecular Formula:
C10H11BrO3
Molecular Weight:
259.0965
IUPAC Name:
methyl 2-(4-bromo-2-methoxyphenyl)acetate
InChI:
InChI=1S/C10H11BrO3/c1-13-9-6-8(11)4-3-7(9)5-10(12)14-2/h3-4,6H,5H2,1-2H3
InChI Key:
SNBSVSYZDNKNHA-UHFFFAOYSA-N
SMILES:
COC(=O)Cc1ccc(cc1OC)Br
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.989g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.099g/mol
Monoisotopic Mass:
257.989g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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